2-bromo-3-fluoropyridine-4-carbaldehyde;hydrate


Chemical Name: 2-bromo-3-fluoropyridine-4-carbaldehyde;hydrate
CAS Number: 1227572-94-2
Product Number: AG000JB6(AGN-PC-0AC144)
Synonyms:
MDL No:
Molecular Formula: C6H3BrFNO
Molecular Weight: 203.9965

Identification/Properties


Computed Properties
Molecular Weight:
222.013g/mol
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
220.949g/mol
Monoisotopic Mass:
220.949g/mol
Topological Polar Surface Area:
31A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
133
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
2
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
N/A
Signal Word:
UN#:
N/A
Hazard Statements:
-
Precautionary Statements:
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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